>compound Uracil_Uracil
#instrument UPLC Q-Tof Premier, Waters
>formula C4H4N2O2
#smiles O=C(C=1)NC(=O)NC1
#RECORD LC-ESI-QTOF_train_data/PR100501.txt;LC-ESI-QTOF_train_data/PR100037.txt
>charge -1
>ionization [M-H]-
>parentmass 111.01948

>collision 5-60
111.0195 96.85

>collision 5-60
92.5026 9.015
112.5167 9.848
113.0339 115.0

